SCHEMBL9623565

SCHEMBL9623565

O=C(O)c1cc(Cl)c(OC(CCCOc2ccccc2Cl)C(=O)O)c(Cl)c1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.43
HTT P42858 1/20 0.43
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
PKM P14618 1/20 0.40
PTPN1 P18031 1/20 0.39
TRPM4 Q8TD43 1/20 0.39
RAB9A P51151 7/20 0.39
NPC1 O15118 6/20 0.39
PPARG P37231 3/20 0.39
HPGD P15428 2/20 0.39
PPARA Q07869 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MITF O75030 1/20 0.39
XBP1 P17861 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9623215 0.89 KMT2A (0.40) MEN1KMT2ARAB9APPARGHPGD
SCHEMBL9623483 0.85 MEN1 (0.46) TP53HTTMEN1KMT2APKM
SCHEMBL9623931 0.77 MEN1 (0.48) TP53HTTMEN1KMT2APKM
SCHEMBL27329102 0.73 MEN1 (0.55) TP53HTTMEN1KMT2APKM
SCHEMBL9622907 0.73 PLAU (0.51) TP53MEN1KMT2ARAB9ANPC1
SCHEMBL9696348 0.71 PPARG (0.52) MEN1KMT2ARAB9ANPC1PPARG
SCHEMBL9623562 0.71 PPARG (0.39) MEN1KMT2APTPN1RAB9ANPC1
SCHEMBL9623390 0.71 PPARG (0.43) KMT2ARAB9ANPC1PPARGHPGD
SCHEMBL9623199 0.69 FOLH1 (0.43) MEN1KMT2APTPN1RAB9ANPC1
SCHEMBL9623393 0.69 MRGPRX4 (0.46) KMT2ARAB9ANPC1PPARGHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0212944-B1 MELT-PROCESSABLE AROMATIC COPOLYESTER Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1992-04-08 EP disclosed
US-4746721-A ENGINEERING PLASTICS KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1988-05-24 US disclosed
EP-0212944-A2 Melt-processable aromatic copolyester Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1987-03-04 EP disclosed